Crystallography Open Database

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9007588 CIFCu3 H4 I6 O20P -17.256; 7.9503; 7.8559
105.096; 92.945; 96.952
432.702Ghose, S.; Wan, C.
Structural chemistry of copper and zinc minerals. II. Stereochemistry of copper(II) and iodine(V) in bellingerite, 3Cu(IO3)2.2H2O
Acta Crystallographica, Section B, 1974, 30, 965-974
9007589 CIFAl9 Ba3.5 Ca5.5 H2 K0.5 Na0.5 O55 S3 Si11P -6 2 m13.511; 13.511; 7.462
90; 90; 120
1179.67Merlino, S.
The crystal structure of wenkite
Acta Crystallographica, Section B, 1974, 30, 1262-1266
9007590 CIFSb2 Te3R -3 m :H4.264; 4.264; 30.458
90; 90; 120
479.586Anderson, T. L.; Krause, H. B.
Refinement of the Sb2Te3 and Sb2Te3Se structures and their relationship to nonstoichiometric Sb2Te(3-y)Se(y) compounds Sample: T = 29 C
Acta Crystallographica, Section B, 1974, 30, 1307-1310
9007591 CIFSb2 Se Te2R -3 m :H4.188; 4.188; 29.937
90; 90; 120
454.729Anderson, T. L.; Krause, H. B.
Refinement of the Sb2Te3 and Sb2Te3Se structures and their relationship to nonstoichiometric Sb2Te(3-y)Se(y) compounds Sample: T = 29 C
Acta Crystallographica, Section B, 1974, 30, 1307-1310
9007592 CIFAl3 H4 Na O12 P2P 1 21/n 111.233; 10.142; 7.097
90; 97.37; 90
801.847Gatehouse, B. M.; Miskin, B. K.
The crystal structure of brazilianite, NaAl3(PO4)2(OH)4
Acta Crystallographica, Section B, 1974, 30, 1311-1317
9007593 CIFS8P 1 2/c 18.442; 13.025; 9.356
90; 124.98; 90
842.915Watanabe, Y.
The crystal structure of monoclinic gamma-sulfur
Acta Crystallographica, Section B, 1974, 30, 1396-1401
9007594 CIFAs5 Ca6.25 H20 O30P 1 21/n 117.63; 6.734; 23.47
90; 90.6; 90
2786.22Catti, M.; Ferraris, G.
Crystal structure of Ca5(HAsO4)2(AsO4)2*9H2O (guerinite)
Acta Crystallographica, Section B, 1974, 30, 1789-1794
9007595 CIFO4 Sn WP n n a5.627; 11.6486; 4.9973
90; 90; 90
327.556Jeitschko, W.; Sleight, A. W.
Alpha stannous tungstate: Properties, crystal structure and relationship to ferroelectric SbTaO4 type compounds
Acta Crystallographica, Section B, 1974, 30, 2088-2094
9007596 CIFB3 H15 Mg O13P -18.3479; 10.6068; 6.4447
98.846; 108.981; 105.581
501.239Corazza, E.
The crystal structure of kurnakovite: a refinement
Acta Crystallographica, Section B, 1974, 30, 2194-2199
9007597 CIFF H28 Na7 O27 P2F d -3 c :227.755; 27.755; 27.755
90; 90; 90
21380.8Baur, W. H.; Tillmanns, E.
Salt hydrates. X. The crystal structure determinations of heptasodium fluoride bisphosphate 19-hydrate and heptasodium fluoride bisarsenate 19-hydrate and the computer simulation of the isomorphous vanadate salt Note: not all H were located Locality: synthetic
Acta Crystallographica, Section B, 1974, 30, 2218-2224
9007598 CIFAs2 F H28 Na7 O27F d -3 c :228.12; 28.12; 28.12
90; 90; 90
22235.5Baur, W. H.; Tillmanns, E.
Salt hydrates. X. The crystal structure determination of heptasodium fluoride bisphosphate 19-hydrate and heptasodium fluoride bisarsenate 19-hydrate and the computer simulation of the isomorphous vanadate salt
Acta Crystallographica, Section B, 1974, 30, 2218-2224
9007599 CIFMg2 O7 V2P -113.767; 5.414; 4.912
81.42; 106.82; 130.33
266.795Gopal, R.; Calvo, C.
Crystal structure of magnesium divanadate, Mg2V2O7 Note: There is likely a minor typo in coordinates of O6 because bond lengths cannot be reproduced
Acta Crystallographica, Section B, 1974, 30, 2491-2493
9007600 CIFCo2 O7 V2P 1 21/c 16.594; 8.38; 9.47
90; 100.17; 90
515.069Sauerbrei, E. E.; Faggiani, R.; Calvo, C.
Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7
Acta Crystallographica, Section B, 1974, 30, 2907-2909
9007601 CIFNi2 O7 V2P 1 21/c 16.515; 8.303; 9.35
90; 99.86; 90
498.309Sauerbrei, E. E.; Faggiani, R.; Calvo, C.
Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7 Note: x-coordinate of O7 altered to reproduce reported bond lengths
Acta Crystallographica, Section B, 1974, 30, 2907-2909
9007602 CIFCl Cu2 H3 O3R -3 :H13.654; 13.654; 14.041
90; 90; 120
2266.98Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Ordered structure, considered to be the true structure
Acta Crystallographica, Section B, 1975, 31, 183-187
9007603 CIFCl Cu2 H3 O3R -3 :H6.827; 6.827; 14.041
90; 90; 120
566.746Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, can be considered as the average structure
Acta Crystallographica, Section B, 1975, 31, 183-187
9007604 CIFCl Cu2 O3R -3 :H6.827; 6.827; 14.041
90; 90; 120
566.746Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, with disordered oxygens
Acta Crystallographica, Section B, 1975, 31, 183-187
9007605 CIFAs Fe H4 O6P b c a10.325; 8.953; 10.038
90; 90; 90
927.91Kitahama, K.; Kiriyama, R.; Yoshihisa, B.
Refinement of the crystal structure of scorodite
Acta Crystallographica, Section B, 1975, 31, 322-324
9007606 CIFCu2 O7 V2F d d 220.645; 8.383; 6.442
90; 90; 90
1114.9Calvo, C.; Faggiani, R.
Alpha cupric divanadate
Acta Crystallographica, Section B, 1975, 31, 603-605
9007607 CIFB2 Ca3 O6R -3 c :H8.6377; 8.6377; 11.849
90; 90; 120
765.612Vegas, A.; Cano, F. H.; Garcia-Blanco S
The crystal structure of calcium orthoborate: a redetermination
Acta Crystallographica, Section B, 1975, 31, 1416-1419
9007608 CIFCu H4 Na2 O10 S2P 1 21/c 15.807; 12.656; 5.517
90; 108.32; 90
384.912Hawthorne, F. C.; Ferguson, R. B.
Refinement of the crystal structure of krohnkite
Acta Crystallographica, Section B, 1975, 31, 1753-1755
9007609 CIFO3 Sb2F d -3 m :111.1519; 11.1519; 11.1519
90; 90; 90
1386.91Svensson, C.
Refinement of the crystal structure of cubic antiomony trioxide, Sb2O3
Acta Crystallographica, Section B, 1975, 31, 2016-2018
9007610 CIFLi0.55 Mn4 Na0.45 O15 Si5P -17.621; 11.761; 6.731
92.767; 95.083; 106.867
573.345Narita, H.; Koto, K.; Morimoto, N.; Yoshii, M.
The crystal structure of nambulite (Li,Na)Mn4Si5O14(OH)
Acta Crystallographica, Section B, 1975, 31, 2422-2426
9007611 CIFCa3 H6 O10 Si2C 1 c 116.278; 5.6321; 13.236
90; 134.898; 90
859.577Malik, K. M. A.; Jeffery, J. W.
A re-investigation of the structure of afwillite
Acta Crystallographica, Section B, 1976, 32, 475-480
9007612 CIFB3 H15 Mg O13P 1 21/c 16.8221; 13.1145; 12.035
90; 104.552; 90
1042.21Corazza, E.
Inderite: Crystal structure refinement and relationship to kurnakovite
Acta Crystallographica, Section B, 1976, 32, 1329-1333
9007613 CIFAs H9 Mg O8P b c a7.472; 10.891; 16.585
90; 90; 90
1349.65Protas, J.; Gindt, R.
Structure cristalline de la brassite, MgHAsO4*4H2O, produit de deshydratation de la roesslerite Locality: synthetic
Acta Crystallographica, Section B, 1976, 32, 1460-1466
9007614 CIFAs3 Ca2 Mg1.7 Mn0.3 Na O12I a -3 d12.355; 12.355; 12.355
90; 90; 90
1885.94Hawthorne, F. C.
Refinement of the crystal structure of berzeliite Note: garnet structure
Acta Crystallographica, Section B, 1976, 32, 1581-1583
9007615 CIFBi5 Cu Pb S9P b n m33.531; 11.486; 4.003
90; 90; 90
1541.7Kohatsu, I.; Wuensch, B. J.
The crystal structure of gladite, PbCuBi5S9, a superstructure intermediate in the series Bi2S3-PbCuBiS3 (bismuthinite-aikinite)
Acta Crystallographica, Section B, 1976, 32, 2401-2409
9007616 CIFCa0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.014 O4 P0.965P m n b5.918; 10.037; 4.798
90; 90; 90
284.996Alberti, A.
Crystal structure of ferrisicklerite, Li<1(Fe3+,Mn2+)PO4
Acta Crystallographica, Section B, 1976, 32, 2761-2764
9007617 CIFO4 Pb WP 1 21/a 113.555; 4.976; 5.561
90; 107.63; 90
357.471Fujita, T.; Kawada, I.; Kato, K.
Raspite from Broken Hill
Acta Crystallographica, Section B, 1977, 33, 162-164
9007618 CIFAl H4 O6 PP b c a9.822; 8.561; 9.63
90; 90; 90
809.75Kniep, R.; Mootz, D.; Vegas, A.
Variscite
Acta Crystallographica, Section B, 1977, 33, 263-265
9007619 CIFCa4 H4 O16 P4P -16.91; 6.627; 6.998
96.34; 103.82; 88.33
309.275Catti, M.; Ferraris, G.; Filhol, A.
Hydrogen bonding in the crystalline state. CaHPO4 (monetite), P-1 or P1? A novel neutron diffraction study
Acta Crystallographica, Section B, 1977, 33, 1223-1229
9007620 CIFC4 H10 Mg5 O18P 1 21/c 110.105; 8.954; 8.378
90; 114.44; 90
690.118Akao, M.; Iwai, S.
The hydrogen bonding of hydromagnesite
Acta Crystallographica, Section B, 1977, 33, 1273-1275
9007621 CIFAs2 Ca Fe O7 SbI 41/a :216.144; 16.144; 10.706
90; 90; 90
2790.29Coda, A.; Dal Negro, A.; Sabelli, C.; Tazzoli, V.
The crystal structure of stenhuggarite
Acta Crystallographica, Section B, 1977, 33, 1807-1811
9007622 CIFAl2 Ba0.24 H10 K0.01 O21 Si6 Sr0.71P 1 21/m 16.793; 17.573; 7.759
90; 94.54; 90
923.312Schlenker, J. L.; Pluth, J. J.; Smith, J. V.
Refinement of the crystal structure of brewsterite, Ba0.5Sr1.5Al4Si12O32*10H2O
Acta Crystallographica, Section B, 1977, 33, 2907-2910
9007623 CIFC0.5 H4 Mg O4C 1 2/m 116.56; 3.153; 6.231
90; 99.1; 90
321.249Akao, M.; Iwai, S.
The hydrogen bonding of artinite Note: anisotropic displacement parameters obtained from ICSD
Acta Crystallographica, Section B, 1977, 33, 3951-3953
9007624 CIFO4 Si ThI 41/a m d :27.1328; 7.1328; 6.3188
90; 90; 90
321.481Taylor, M.; Ewing, R. C.
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite
Acta Crystallographica, Section B, 1978, 34, 1074-1079
9007625 CIFO4 Si ThP 1 21/n 16.784; 6.974; 6.5
90; 104.92; 90
297.158Taylor, M.; Ewing, R. C.
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite
Acta Crystallographica, Section B, 1978, 34, 1074-1079
9007626 CIFAl2 H18 O15 SP 1 21/c 17.44; 15.583; 11.7
90; 110.18; 90
1273.2Sabelli, C.; Ferroni, R. T.
The crystal structure of aluminite Note: anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1978, 34, 2407-2412
9007627 CIFO4 Si Zn2R -3 :H13.948; 13.948; 9.315
90; 90; 120
1569.41Klaska, K.-H.; Eck, J. C.; Pohl, D.
New investigation of willemite Note: Anisotropic displacement parameters are from ICSD
Acta Crystallographica, Section B, 1978, 34, 3324-3325
9007628 CIFAs2 Cu3 H2 O10 PbC 1 2/c 110.147; 5.892; 14.081
90; 106.05; 90
809.034Ghose, S.; Wan, C.
Structural chemistry of copper and zinc minerals. VI. Bayldonite, (Cu,Zn)3Pb(AsO4)2(OH)2: A complex layer structure
Acta Crystallographica, Section B, 1979, 35, 819-823
9007629 CIFAs H Mn4 O13 Si3P 1 21/n 16.66; 19.92; 7.67
90; 95.7; 90
1012.53Gramaccioli, C. M.; Pilati, T.; Liborio, G.
Structure of a manganese(II) arsenatotrisilicate, Mn4[AsSi3O12(OH)]: The presence of a new tetrapolyphosphate-like anion Note: Displacement parameters taken from ICSD
Acta Crystallographica, Section B, 1979, 35, 2287-2291
9007630 CIFBa5 Cl O12 P3P 63/m10.284; 10.284; 7.651
90; 90; 120
700.766Hata, M.; Marumo, F.; Iwai, S.; Aoki, H.
Structure of barium chlorapatite
Acta Crystallographica, Section B, 1979, 35, 2382-2384
9007631 CIFAl Cl Cu H28 O22 S2P -16.282; 13.192; 6.26
91.85; 94.7; 82.46
512.443Ginderow, D.; Cesbron, F.
Structure cristalline de l'aubertite, AlCuCl(SO4)2*14H2O Note: anisotropic displacement parameters obtained from ICSD
Acta Crystallographica, Section B, 1979, 35, 2499-2502
9007632 CIFH7 Mg O7 PP b c a10.203; 10.678; 10.015
90; 90; 90
1091.11Abbona, F.; Boistelle, R.; Haser, R.
Hydrogen bonding in MgHPO4*3H2O (newberyite)
Acta Crystallographica, Section B, 1979, 35, 2514-2518
9007633 CIFAl2 H6 K Na O10.765 Si2I 1 2 110.226; 10.422; 9.884
90; 88.19; 90
1052.86Alberti, A.; Vezzalini, G.
The crystal structure of amicite, a zeolite
Acta Crystallographica, Section B, 1979, 35, 2866-2869
9007634 CIFAl2 O3R -3 c :H4.754; 4.754; 12.99
90; 90; 120
254.248Ishizawa, N.; Miyata, T.; Minato, I.; Marumo, F.; Iwai, S.
A structural investigation of alpha-Al2O3 at 2170 K T = 300 K
Acta Crystallographica, Section B, 1980, 36, 228-230
9007635 CIFAl2 O3R -3 c :H4.844; 4.844; 13.27
90; 90; 120
269.656Ishizawa, N.; Miyata, T.; Minato, I.; Marumo, F.; Iwai, S.
A structural investigation of alpha-Al2O3 at 2170 K T = 2170 K
Acta Crystallographica, Section B, 1980, 36, 228-230
9007636 CIFCa2 H K2 Na O20 Si7 TiP -110.377; 12.166; 7.059
90.91; 99.3; 92.76
878.187Bissert, G.
Verfeinerung der struktur von tinaksit, Ca2K2NaTiO[Si7O18(OH)] Note: z-coordinate of Si4 adjusted to match reported bond lengths
Acta Crystallographica, Section B, 1980, 36, 259-263
9007637 CIFAs O2P n m a8.597; 5.235; 7.269
90; 90; 90
327.143Jones, P. G.; Beesk, W.; Sheldrick, G. M.; Schwarzmann, E.
Arsenic dioxide
Acta Crystallographica, Section B, 1980, 36, 439-440
9007638 CIFK Na O4 SP 3 m 15.6066; 5.6066; 7.177
90; 90; 120
195.377Okada, K.; Ossaka, J.
Structures of potassium sodium sulphate and tripotassium sodium disulphate
Acta Crystallographica, Section B, 1980, 36, 919-921
9007639 CIFK3 Na O8 S2P -3 m 15.6801; 5.6801; 7.309
90; 90; 120
204.221Okada, K.; Ossaka, J.
Structures of potassium sodium sulphate and tripotassium sodium disulphate
Acta Crystallographica, Section B, 1980, 36, 919-921
9007640 CIFNi3 S2R 3 2 :R4.0718; 4.0718; 4.0718
89.459; 89.459; 89.459
67.5Parise, J. B.
Structure of hazelwoodite (Ni3S2)
Acta Crystallographica, Section B, 1980, 36, 1179-1180
9007641 CIFH42 Mg9 Mn1.882 O42 S2 Zn4P 1 21/a 111.147; 20.35; 8.202
90; 92.69; 90
1858.5Hill, R. J.
The structure of mooreite Note: Isotropic and anisotropic displacement factors taken from ICSD
Acta Crystallographica, Section B, 1980, 36, 1304-1311
9007642 CIFCa Cl6 H24 Mg2 O12R -3 :H10.136; 10.136; 17.318
90; 90; 120
1540.85Clark, J. R.; Evans, H. T.; Erd, R. C.
Tachyhydrite, dimagnesium calcium chloride 12-hydrate
Acta Crystallographica, Section B, 1980, 36, 2736-2739
9007643 CIFC O2P a -35.624; 5.624; 5.624
90; 90; 90
177.884Simon, A.; Peters, K.
Single-crystal refinement of the structure of carbon dioxide Sample: T = 150 K
Acta Crystallographica, Section B, 1980, 36, 2750-2751
9007644 CIFFe3 O4F d -3 m :28.3941; 8.3941; 8.3941
90; 90; 90
591.456Fleet, M. E.
The structure of magnetite
Acta Crystallographica, Section B, 1981, 37, 917-920
9007645 CIFC3 H10 Ca Na2 O16 UR -3 m :H17.902; 17.902; 23.734
90; 90; 120
6587.26Coda, A.; Della Giusta, A.; Tazzoli, V.
The structure of synthetic andersonite, Na2Ca[UO2(CO3)3].x(H2O) (x~5.6) Note: anisotropic displacement factors are from ICSD Note: B(2,2) for C2 changed to reproduce Biso and make positive definite
Acta Crystallographica, Section B, 1981, 37, 1496-1500
9007646 CIFBa0.1 Fe0.52 K0.66 Mg0.12 Na0.02 O8 Ti3.36I 4/m10.139; 10.139; 2.9664
90; 90; 90
304.944Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007647 CIFAl0.08 Fe0.16 K0.65 Mn3.76 Na0.11 O8 Sr0.08I 1 2/m 19.956; 2.8705; 9.706
90; 90.95; 90
277.347Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: -1M polytype Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007648 CIFAl0.12 Ba0.34 Fe0.64 Mn3.24 O8 Pb0.08I 1 2/m 110.026; 2.8782; 9.729
90; 91.03; 90
280.703Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007649 CIFNa0.5 O13 Si3 Y4.5P 63/m9.334; 9.334; 6.759
90; 90; 120
509.975Gunawardane, R. P.; Howie, R. A.; Glasser, F. P.
Structure of the oxyapatite NaY9(SiO4)6O2 Note: apatite structure
Acta Crystallographica, Section B, 1982, 38, 1564-1566
9007650 CIFFe SP -6 2 c5.963; 5.963; 11.754
90; 90; 120
361.948King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 0.0001 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007651 CIFFe SP -6 2 c5.999; 5.999; 11.71
90; 90; 120
364.96King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 393 K, P = 0.0001 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007652 CIFFe SP -6 2 c5.861; 5.861; 11.577
90; 90; 120
344.406King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 3.33 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007653 CIFFe SP n m a5.825; 3.4675; 6.0059
90; 90; 90
121.308King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 463 K, P = 0.0001 GPa, MnP-type structure
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007654 CIFFe SP n m a5.716; 3.347; 5.797
90; 90; 90
110.905King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 4.15 GPa, MnP-type structure Note: a cell edge altered from value reported
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007655 CIFFe SP n m a5.65; 3.3155; 5.7426
90; 90; 90
107.574King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 6.35 GPa, MnP-type structure
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007656 CIFC2 H5 Na3 O8C 1 2/c 120.36; 3.48; 10.29
90; 106.48; 90
699.124Choi, C. S.; Mighell, A. D.
Neutron diffraction study of sodium sesquicarbonate dihydrate Note: H3 disordered model, this is the prefered model
Acta Crystallographica, Section B, 1982, 38, 2874-2876
9007657 CIFC2 H5 Na3 O8C 1 2/c 120.36; 3.48; 10.29
90; 106.48; 90
699.124Choi, C. S.; Mighell, A. D.
Neutron diffraction study of sodium sesquicarbonate dihydrate Note: H3 ordered model, this is least favoured
Acta Crystallographica, Section B, 1982, 38, 2874-2876
9007658 CIFB5 Ca H10 Na O14P 1 21/c 16.588; 12.56; 13.428
90; 99.97; 90
1094.32Menchetti, S.; Sabelli, C.; Trosti-Ferroni R
Probertite, CaNa[B5O7(OH)4]*3H2O: a refinement
Acta Crystallographica, Section B, 1982, 38, 3072-3075
9007659 CIFNi53 S54P 31 2 110.29; 10.29; 15.993
90; 90; 120
1466.53Collin, G.; Chavant, C.; Comes, R.
Structure and planar faults in the defective NiAs-type compound Ni17S18
Acta Crystallographica, Section B, 1983, 39, 289-296
9007660 CIFMo S2P 63/m m c3.161; 3.161; 12.295
90; 90; 120
106.392Schonfeld, B.; Huang, J. J.; Moss, S. C.
Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 2H polytype, this is the most common in nature
Acta Crystallographica, Section B, 1983, 39, 404-407
9007661 CIFMo S2R 3 m :H3.163; 3.163; 18.37
90; 90; 120
159.162Schonfeld, B.; Huang, J. J.; Moss, S. C.
Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 3R polytype
Acta Crystallographica, Section B, 1983, 39, 404-407
9007662 CIFAs CoP n a m5.2857; 5.8675; 3.4883
90; 90; 90
108.186Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pnam refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007663 CIFAs CoP n a 215.2857; 5.8675; 3.4883
90; 90; 90
108.186Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pna2_1 refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007664 CIFAs CoP n a m5.2675; 5.815; 3.4623
90; 90; 90
106.052Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 2.80 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007665 CIFAs CoP n a m5.2631; 5.801; 3.4569
90; 90; 90
105.543Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 3.70 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007666 CIFAs CoP n a m5.2575; 5.7782; 3.4453
90; 90; 90
104.664Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 4.90 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007667 CIFAs FeP n a 215.4401; 6.0259; 3.3712
90; 90; 90
110.513Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pna2_1 refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007668 CIFAs FeP n a m5.4401; 6.0259; 3.3712
90; 90; 90
110.513Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pnam refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007669 CIFAs FeP n a m5.424; 5.9948; 3.3386
90; 90; 90
108.557Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 2.25 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007670 CIFAs FeP n a m5.411; 5.9671; 3.3122
90; 90; 90
106.944Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 4.36 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007671 CIFAs FeP n a m5.403; 5.9488; 3.2902
90; 90; 90
105.752Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 6.10 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007672 CIFAs FeP n a m5.39; 5.928; 3.2662
90; 90; 90
104.361Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 8.3 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007673 CIFMn O3 TiR -3 :H5.139; 5.139; 14.283
90; 90; 120
326.669Kidoh, K.; Tanaka, K.; Marumo, F.; Takei, H.
Electron density distribution in ilmenite-type crystals. II. Manganese (II) titanium (IV) trioxide Sample: ilmenite structure
Acta Crystallographica, Section B, 1984, 40, 329-332
9007674 CIFH16 Mg N O10 PP m n 216.955; 6.142; 11.218
90; 90; 90
479.206Ferraris, G.; Fuess, H.; Joswig, W.
Neutron diffraction study of MgNH4PO4*6H2O (struvite) and survey of water molecules donating short hydrogen bonds
Acta Crystallographica, Section B, 1986, 42, 253-258
9007675 CIFB H3 O3P -17.0187; 7.035; 6.3472
92.49; 101.46; 119.76
262.901Gajhede, M.; Larsen, S.; Rettrup, S.
Electron density of orthoboric acid determined by X-ray diffraction at 105 K and ab initio calculations Note: multipole refinement
Acta Crystallographica, Section B, 1986, 42, 545-552
9007676 CIFAl1.5 H4 Na1.875 O6.125 S1.125 Si1.5I -4 3 m9.0338; 9.0338; 9.0338
90; 90; 90
737.244Tarling, S. E.; Barnes, P.; Klinowski, J.
The structure and Si,Al distribution of the ultramarines Note: disordered synthetic counterpart to lazurite Note: occupancies changed to match formula
Acta Crystallographica, Section B, 1988, 44, 128-135
9007677 CIFAs3 Ni8.499 O16R -3 m :R9.8105; 9.8105; 9.8105
35.312; 35.312; 35.312
281.837Fleet, M. E.; Barbier, J.
Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series
Acta Crystallographica, Section B, 1989, 45, 201-205
9007678 CIFGe3 Mg5.467 Ni4.533 O16R -3 m :R10.125; 10.125; 10.125
33.79; 33.79; 33.79
286.075Fleet, M. E.; Barbier, J.
Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series
Acta Crystallographica, Section B, 1989, 45, 201-205
9007679 CIFK O5 P TiP n a 2112.819; 6.399; 10.584
90; 90; 90
868.193Thomas, P. A.; Glazer, A. M.; Watts, B. E.
Crystal structure and nonlinear optical properties of KSnOPO4 and their comparison with KTiOPO4 Note: KTP structure
Acta Crystallographica, Section B, 1990, 46, 333-343
9007680 CIFK O5 P SnP n a 2113.145; 6.526; 10.738
90; 90; 90
921.151Thomas, P. A.; Glazer, A. M.; Watts, B. E.
Crystal structure and nonlinear optical properties of KSnOPO4 and their comparison with KTiOPO4 Note: KTP structure
Acta Crystallographica, Section B, 1990, 46, 333-343
9007681 CIFC4 H3 Na5 O12P -13.4762; 10.0393; 15.5969
107.77; 95.589; 95.028
511.906Fernandes, N. G.; Tellgren, R.; Olovsson, I.
Structure and electron density of pentasodium trihydrogentetracarbonate Note: anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1990, 46, 466-474
9007682 CIFCo S2P a -35.5385; 5.5385; 5.5385
90; 90; 90
169.893Nowack, E.; Schwarzenbach, D.; Hahn, T.
Charge densities in CoS2 and NiS2 (pyrite structure) Note: multipole model
Acta Crystallographica, Section B, 1991, 47, 650-659
9007683 CIFNi S2P a -35.6765; 5.6765; 5.6765
90; 90; 90
182.912Nowack, E.; Schwarzenbach, D.; Hahn, T.
Charge densities in CoS2 and NiS2 (pyrite structure) Note: multipole model, T = 135 K
Acta Crystallographica, Section B, 1991, 47, 650-659
9007684 CIFAs2 Ni3 O8P 1 21/c 15.764; 9.559; 10.194
90; 92.95; 90
560.925Barbier, J.; Frampton, C.
Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD
Acta Crystallographica, Section B, 1991, 47, 457-462
9007685 CIFAs2 Ni3 O8C m c e5.943; 11.263; 8.164
90; 90; 90
546.466Barbier, J.; Frampton, C.
Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD Note: polymorph of xanthiosite
Acta Crystallographica, Section B, 1991, 47, 457-462
9007689 CIFC Ca O3R -3 c :H4.988; 4.988; 17.068
90; 90; 120
367.761Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3
Acta Crystallographica, Section B, 1995, 51, 929-939
9007690 CIFC Mn O3R -3 c :H4.772; 4.772; 15.637
90; 90; 120
308.379Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3 Sample: Synchrotron data
Acta Crystallographica, Section B, 1995, 51, 929-939
9007692 CIFC Mg O3R -3 c :H4.632; 4.632; 15.002
90; 90; 120
278.751Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3
Acta Crystallographica, Section B, 1995, 51, 929-939
9007694 CIFCo0.06 Cu0.68 Fe0.11 Ni0.15 S2P 1 21 15.709; 5.707; 5.708
90; 90.01; 90
185.974Marcos, C.; Paniagua, A.; Moreiras, D. B.; Garcia-Granda S; Diaz, M. R.
Villamaninite, a case of noncubic pyrite-type structure Sample: 1 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1996, 52, 899-904
9007695 CIFCo0.13 Cu0.53 Fe0.07 Ni0.27 S2P 1 21 15.704; 5.703; 5.704
90; 89.99; 90
185.551Marcos, C.; Paniagua, A.; Moreiras, D. B.; Garcia-Granda S; Diaz, M. R.
Villamaninite, a case of noncubic pyrite-type structure Sample: 2 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1996, 52, 899-904
9007697 CIFCu6 O8 PbF m -3 m9.314; 9.314; 9.314
90; 90; 90
807.995Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.
Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at ambient conditions
Acta Crystallographica, Section B, 2000, 56, 22-26
9007698 CIFCu6 O8 PbF m -3 m8.623; 8.623; 8.623
90; 90; 90
641.173Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.
Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at high pressure
Acta Crystallographica, Section B, 2000, 56, 22-26
9007701 CIFAl2 Mn3 O12 Si3I a -3 d11.63; 11.63; 11.63
90; 90; 90
1573.04Gramaccioli, C. M.; Pilati, T.; Demartin, F.
Atomic displacement parameters for spessartine Mn3Al2Si3O12 and their lattice-dynamical interpretation
Acta Crystallographica, Section B, 2002, 58, 965-969
9007703 CIFAs D9 O10 UP 4/n c c :27.1615; 7.1615; 17.639
90; 90; 90
904.653Fitch, A. N.; Bernard, L.; Howe, A. T.; Wright, A. F.; Fender, B. E. F.
The room-temperature structure of DUO2AsO4*4D2O by powder neutron diffraction Locality: synthetic
Acta Crystallographica, Section C, 1983, 39, 159-162
9007704 CIFS2 Sb TlP -16.123; 6.293; 11.838
101.34; 98.39; 103.21
426.612Rey, N.; Jumas, J. C.; Olivier-Fourcade J; Philippot, E.
Sur les composes III-V-VI: Etude structurale du disulfure d'antimoine et de thallium, TlSbS2
Acta Crystallographica, Section C, 1983, 39, 971-974
9007705 CIFBr0.36 Cl0.64 Cu6 O7.52 PbF m -3 m9.224; 9.224; 9.224
90; 90; 90
784.798Dubler, E.; Vedani, A.; Oswald, H. R.
New structure determination of murdochite, Cu6PbO8
Acta Crystallographica, Section C, 1983, 39, 1143-1146
9007706 CIFFe3 O4F d -3 m :28.3969; 8.3969; 8.3969
90; 90; 90
592.048Fleet, M. E.
The structure of magnetite: two annealed natural magnetites, Fe3.005O4 and Fe2.96Mg0.04O4 Note: Sample No.633, Fe3.005, annealed at 1373 K for 7 days
Acta Crystallographica, Section C, 1984, 40, 1491-1493
9007707 CIFFe2.961 Mg0.039 O4F d -3 m :28.3975; 8.3975; 8.3975
90; 90; 90
592.175Fleet, M. E.
The structure of magnetite: two annealed natural magnetites, Fe3.005O4 and Fe2.96Mg0.04O4 Note: Sample No.2741, Fe2.96, annealed at 1073 K for 7 days
Acta Crystallographica, Section C, 1984, 40, 1491-1493
9007708 CIFC13 H10P n m a8.365; 18.745; 5.654
90; 90; 90
886.558Gerkin, R. E.; Lundstedt, A. P.; Reppart, W. J.
Structure of fluorene, C~13~H~10~, at 159 K
Acta Crystallographica Section C, 1984, 40, 1892-1894
9007709 CIFAs3 Ca0.4 Ce0.06 Cu6 Fe0.09 H18 La0.04 Nd0.01 O21 Y0.31P 63/m13.583; 13.583; 5.895
90; 90; 120
941.902Aruga, A.; Nakai, I.
Structure of Ca-rich agardite, (Ca0.40Y0.31Fe0.09Ce0.06La0.04Nd0.01)Cu6.19[(AsO4)2.42(HAsO4)0.49](OH)6.38*3H2O Locality: Setoda, Hiroshima, Japan
Acta Crystallographica, Section C, 1985, 41, 161-163
9007710 CIFO PbP b c m5.8931; 5.4904; 4.7528
90; 90; 90
153.779Hill, R. J.
Refinement of the structure of orthorhombic PbO (massicot) by Rietveld analysis of neutron powder diffraction data
Acta Crystallographica, Section C, 1985, 41, 1281-1284
9007711 CIFCa1.543 Na2.914 O9 Si3R -3 m :H10.5; 10.5; 13.184
90; 90; 120
1258.8Ohsato, H.; Maki, I.; Takeuchi, Y.
Structure of Na2CaSi2O6
Acta Crystallographica, Section C, 1985, 41, 1575-1577
9007712 CIFC Ni O3R -3 c :H4.6117; 4.6117; 14.735
90; 90; 120
271.396Pertlik, F.
Structures of hydrothermally synthesized cobalt(II) carbonate and nickel(II) carbonate Locality: synthetic
Acta Crystallographica, Section C, 1986, 42, 4-5
9007713 CIFC Co O3R -3 c :H4.6618; 4.6618; 14.963
90; 90; 120
281.616Pertlik, F.
Structures of hydrothermally synthesized cobalt(II) carbonate and nickel(II) carbonate Locality: synthetic
Acta Crystallographica, Section C, 1986, 42, 4-5
9007714 CIFFe2 Mo3 O8P 63 m c5.781; 5.781; 10.06
90; 90; 120
291.162Kanazawa, Y.; Sasaki, A.
Structure of kamiokite Note: anisoB's taken from ICSD
Acta Crystallographica, Section C, 1986, 42, 9-11
9007715 CIFCa Cl2 H12 O6P 3 2 17.8759; 7.8758; 3.9545
90; 90; 120
212.431Agron, P. A.; Busing, W. R.
Calcium and strontium dichloride hexahydrates by neutron diffraction
Acta Crystallographica, Section C, 1986, 42, 141-143
9007716 CIFCl2 H12 O6 SrP 3 2 17.9596; 7.9596; 4.1243
90; 90; 120
226.289Agron, P. A.; Busing, W. R.
Calcium and strontium dichloride hexahydrates by neutron diffraction
Acta Crystallographica, Section C, 1986, 42, 141-143
9007717 CIFCa2 Na2 O9 Si3P 31 2 110.464; 10.464; 13.168
90; 90; 120
1248.67Ohsato, H.; Takeuchi, Y.; Maki, I.
Structure of Na4Ca4[Si6O18]
Acta Crystallographica, Section C, 1986, 42, 934-937
9007718 CIFCl Cu2 H3 O3P n m a6.03; 6.865; 9.12
90; 90; 90
377.531Parise, J. B.; Hyde, B. G.
The structure of atacamite and its relationship to spinel
Acta Crystallographica, Section C, 1986, 42, 1277-1280
9007719 CIFMn Na O6 Si2C 1 2/c 19.513; 8.621; 5.354
90; 105.14; 90
423.849Ohashi, H.; Osawa, T.; Tsukimura, K.
Refinement of the structure of manganese sodium dimetasilicate Note: pyroxene Note: anisoB's from ICSD
Acta Crystallographica, Section C, 1987, 43, 605-607
9007720 CIFCa3.8 Na4.4 O18 Si6P 31 2 110.464; 10.464; 13.176
90; 90; 120
1249.42Fischer, R. X.; Tillmanns, E.
Revised data for combeite, Na2Ca2Si3O9
Acta Crystallographica, Section C, 1987, 43, 1852-1854
9007721 CIFCa1.5 Na2.64 O9 Si3R -3 m :H10.429; 10.429; 13.149
90; 90; 120
1238.54Fischer, R. X.; Tillmanns, E.
Revised data for combeite, Na2Ca2Si3O9
Acta Crystallographica, Section C, 1987, 43, 1852-1854
9007722 CIFFe0.594 Ni17.406 S16C 2 2 29.3359; 11.2185; 9.43
90; 90; 90
987.649Fleet, M. E.
Structure of godlevskite, Ni9S8
Acta Crystallographica, Section C, 1987, 43, 2255-2257
9007723 CIFBi2 O3P -4 21 c7.739; 7.739; 5.636
90; 90; 90
337.552Blower, S. K.; Greaves, C.
The structure of beta-Bi2O3 from powder neutron diffraction data
Acta Crystallographica, Section C, 1988, 44, 587-589
9007724 CIFC3 Cl Cu N O3P 1 21/c 15.192; 7.945; 16.51
90; 100.24; 90
670.197Norman, R. E.; Rose, N. J.; Stenkamp, R. E.
Mono-amino-acid-copper complexes: syntheses and structures of chloro(glycinato)(methanol)copper(II) and chloro(glycinato)(1-methylimidazole)copper(II)
Acta Crystallographica, Section C, 1990, 46, 1-6
9007725 CIFC6 Cl Cu N3 O2P c a 2124.97; 4.009; 9.116
90; 90; 90
912.555Norman, R. E.; Rose, N. J.; Stenkamp, R. E.
Mono-amino-acid-copper complexes: syntheses and structures of chloro(glycinato)(methanol)copper(II) and chloro(glycinato) (1-methylimidazole)copper(II)
Acta Crystallographica, Section C, 1990, 46, 1-6
9007726 CIFN4 O8 Pt Tc2P -15.178; 7.725; 7.935
69.33; 79.74; 77.41
288.044Rochon, F. D.; Kong, P. C.; Melanson, R.
Tetraammineplatinum(II) bis[pertechnetate(VII)]
Acta Crystallographica, Section C, 1990, 46, 8-10
9007727 CIFCd2 H28 Na2 O32 P6P -17.709; 11.028; 9.231
108.25; 110.06; 79.77
697.913Averbuch-Pouchot M T
Crystal chemistry of cyclo-hexaphosphates. V. structure of cadmium sodium cyclo-hexaphosphate tetradecahydrate
Acta Crystallographica, Section C, 1990, 46, 10-13
9007729 CIFCu3 H2 O9 V2P 1 21/m 17.444; 6.658; 7.759
90; 93.57; 90
383.807Leblanc, M.; Ferey, G.
Room-temperature structures of oxocopper(II) vanadate(V) hydrates, Cu3V2O8(H2O) and CuV2O6(H2O)2
Acta Crystallographica, Section C, 1990, 46, 15-18
9007731 CIFBi0.9 Cu Ni S3 Sb0.1P 21 21 217.514; 12.557; 4.888
90; 90; 90
461.199Bente, K.; Doering, T.; Edenharter, A.; Kupcik, V.; Steins, M.; Wendschuh-Josties M
Structure of the new mineral muckeite, BiCuNiS3
Acta Crystallographica, Section C, 1990, 46, 127-128
9007732 CIFCu2 H3 K O10 S2C 1 2/m 18.955; 6.265; 7.628
90; 117.45; 90
379.772Chevrier, G.; Giester, G.; Jarosch, D.; Zemann, J.
Neutron diffraction study of the hydrogen-bond system in Cu2K(H3O2)(SO4)2
Acta Crystallographica, Section C, 1990, 46, 175-177
9007734 CIFEu Mo6 S8R -3 :R6.5378; 6.5378; 6.5378
88.809; 88.809; 88.809
279.265Kubel, F.; Yvon, K.
Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 112 K
Acta Crystallographica, Section C, 1990, 46, 181-186
9007735 CIFEu Mo6 S8P -16.4692; 6.5651; 6.5986
89.179; 89.184; 88.009
280.024Kubel, F.; Yvon, K.
Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 40 K
Acta Crystallographica, Section C, 1990, 46, 181-186
9007736 CIFBa Mo6 S8R -3 :R6.6441; 6.6441; 6.6441
88.562; 88.562; 88.562
293.025Kubel, F.; Yvon, K.
Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 177 K
Acta Crystallographica, Section C, 1990, 46, 181-186
9007737 CIFBa Mo6 S8P -16.5896; 6.65; 6.6899
88.731; 88.818; 88.059
292.859Kubel, F.; Yvon, K.
Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 173 K
Acta Crystallographica, Section C, 1990, 46, 181-186
9007738 CIFCo D12 F6 O6 SiR -3 :H9.369; 9.369; 9.731
90; 90; 120
739.732Chevrier, G.; Saint-James R
Structure investigation by neutron diffraction of deuterated cobalt fluosilicate hexahydrate
Acta Crystallographica, Section C, 1990, 46, 186-189
9007739 CIFAl F6 H6 K O2P a -38.6464; 8.6464; 8.6464
90; 90; 90
646.407Frenzen, G.; Massa, W.
Kalium-dioxonium-hexafluoroaluminat
Acta Crystallographica, Section C, 1990, 46, 190-192
9007740 CIFNa2 O7 W2C m c 213.7777; 26.6067; 5.429
90; 90; 90
545.68Range, K. J.; Haase, H.
Na2W2O7(II), a high-pressure phase of disodium ditungstate(VI)
Acta Crystallographica, Section C, 1990, 46, 317-318
9007741 CIFF H O3 SP 21 21 214.868; 6.736; 9.359
90; 90; 90
306.89Bartmann, K.; Mootz, D.
Structures of two strong Bronsted acids: (I) fluorosulfuric acid and (II) trifluoromethanesulfonic acid Sample: T = 123 K
Acta Crystallographica, Section C, 1990, 46, 319-320
9007742 CIFC H F3 O3 SP 1 21/n 14.947; 11.26; 8.457
90; 99.21; 90
465.009Bartmann, K.; Mootz, D.
Structures of two strong Bronsted acids: (I) fluorosulfuric acid and (II) trifluoromethanesulfonic acid Sample: T = 173 K
Acta Crystallographica, Section C, 1990, 46, 319-320
9007743 CIFCl2 H12 Ni O12P a -310.3159; 10.3159; 10.3159
90; 90; 90
1097.8Gallucci, J. C.; Gerkin, R. E.
The structure of hexaaquanickel(II) chlorate
Acta Crystallographica, Section C, 1990, 46, 350-354
9007744 CIFBa2 Cu2.941 O6.822 YP m m m3.836; 3.883; 11.686
90; 90; 90
174.065Brodt, K.; Fuess, H.; Paulus, E. F.; Assmus, W.; Kowalewski, J.
Untwinned single crystals of the high-temperature superconductor YBa2Cu3O7-x
Acta Crystallographica, Section C, 1990, 46, 354-358
9007745 CIFCs H O4 SP 1 21/c 18.214; 5.809; 10.984
90; 119.39; 90
456.651Itoh, K.; Ukeda, T.; Ozaki, T.; Nakamura, E.
Redetermination of the structure of caesium hydrogensulfate
Acta Crystallographica, Section C, 1990, 46, 358-361
9007746 CIFBa H8 O5P n m a7.64; 11.403; 5.965
90; 90; 90
519.664Lutz, H. D.; Kellersohn, T.; Vogt, T.
Hydrogen bonding in barium hydroxide trihydrate by neutron diffraction
Acta Crystallographica, Section C, 1990, 46, 361-363
9007747 CIFLi2 O5 Si2P b c n5.683; 4.784; 14.648
90; 90; 90
398.242Smith, R. I.; Howie, R. A.; West, A. R.; Aragon-Pina A; Villafuerte-Castrejon M E
The structure of metastable lithium disilicate, Li2Si2O5
Acta Crystallographica, Section C, 1990, 46, 363-365
9007748 CIFS4 Tm2 ZnP n m a13.308; 7.769; 6.285
90; 90; 90
649.805Lemoine, P.; Tomas, A.; Vovan, T.; Guittard, M.
Structure du sulfure de thulium et de zinc ZnTm2S4
Acta Crystallographica, Section C, 1990, 46, 365-368
9007749 CIFI2 Na4 OI 4/m m m4.655; 4.655; 15.94
90; 90; 90
345.404Sabrowsky, H.; Hippler, K.; Sitta, S.; Vogt, P.; Walz, L.
Structure of Na4OI2
Acta Crystallographica, Section C, 1990, 46, 368-369
9007750 CIFB2 Ba2 Cu O6P n m a8.023; 11.29; 13.889
90; 90; 90
1258.06Smith, R. W.; Keszler, D. A.
Structure of Ba2Cu(BO3)2
Acta Crystallographica, Section C, 1990, 46, 370-372
9007752 CIFAl2.26 Nb0.8 Ti2.94P -3 m 14.5554; 4.5554; 5.5415
90; 90; 120
99.589Shoemaker, C. B.; Shoemaker, D. P.; Bendersky, L. A.
Structure of omega-Ti3Al2.25Nb.75
Acta Crystallographica, Section C, 1990, 46, 374-377
9007753 CIFS3 Tm2R -3 c :H6.768; 6.768; 18.236
90; 90; 120
723.404Range, K. J.; Drexler, H.; Gietl, A.; Klement, U.; Lange, K. G.
Tm2S3-V, a corundum-type modification of thulium sesquisulfide
Acta Crystallographica, Section C, 1990, 46, 487-488
9007754 CIFMo3 N2 O10P n m a13.182; 7.589; 9.286
90; 90; 90
928.955Range, K. J.; Fassler, A.
Diammonium trimolybdate(VI), (NH4)2Mo3O10
Acta Crystallographica, Section C, 1990, 46, 488-489
9007755 CIFC8 Ge2 I9 NC 1 2/c 117.953; 9.99; 17.509
90; 108.87; 90
2971.47Muller, V. U.; Krug, V.
Tetraethylammoniumiodid-germaniumtetraiodid(1/2), eine strukture mit einem von acht iodatomen koordinierten iodidion
Acta Crystallographica, Section C, 1990, 46, 523-525
9007756 CIFH2 N3 O10 YP -17.388; 7.889; 8.204
64.43; 70.9; 62.74
378.39Ribar, B.; Radivojevic, P.; Argay, G.; Kalman, A.
Structure of yttrium nitrate monohydrate
Acta Crystallographica, Section C, 1990, 46, 525-527
9007757 CIFPb5.05 S13 Sb4.95I 1 2/m 123.698; 3.98; 24.466
90; 93.9; 90
2302.24Skowron, A.; Brown, I. D.
Refinement of the structure of robinsonite, Pb4Sb6S13
Acta Crystallographica, Section C, 1990, 46, 527-731
9007758 CIFPb4.65 S11 Sb4.35P n a m23.49; 21.245; 4.02
90; 90; 90
2006.16Skowron, A.; Brown, I. D.
Refinement of the structure of boulangerite, Pb5Sb4S11
Acta Crystallographica, Section C, 1990, 46, 531-534
9007759 CIFPb1.44 S5 Sb2.56P b n m11.355; 19.783; 4.042
90; 90; 90
907.979Skowron, A.; Brown, I. D.
Structure of Pb2Sb2S5
Acta Crystallographica, Section C, 1990, 46, 534-536
9007760 CIFNa0.56 O5 V2C 1 2/m 111.663; 3.6532; 8.92
90; 90.91; 90
380.009Kanke, Y.; Kato, K.; Takayama-Muromachi E; Isobe, M.
Structure of Na0.56V2O5
Acta Crystallographica, Section C, 1990, 46, 536-538
9007761 CIFBr4 Ca Mn O8C 1 2/m 19.062; 9.582; 9.405
90; 112.96; 90
751.958Duhlev, R.; Brown, I. D.
Structure of calcium manganese(II) tetrabromide octahydrate
Acta Crystallographica, Section C, 1990, 46, 538-541
9007762 CIFAs Cl2 O3 Pb2P 1 21/m 16.41; 5.525; 9.293
90; 90.69; 90
329.09Effenberger, H.; Miletich, R.; Pertlik, F.
Structure of dilead(II) hydrogenarsenate(III) dichloride
Acta Crystallographica, Section C, 1990, 46, 541-543
9007763 CIFCa1.003 Ge2 Na1.997 O6R -3 m :H10.788; 10.788; 13.46
90; 90; 120
1356.62Nishi, F.; Takeuchi, Y.
Structure of sodium calcium germanate Na2CaGe2O6
Acta Crystallographica, Section C, 1990, 46, 544-546
9007764 CIFCu2 O7 P2C 1 2/c 16.895; 8.113; 9.164
90; 109.62; 90
482.863Effenberger, H.
Structural refinement of low-temperature copper(II) pyrophosphate
Acta Crystallographica, Section C, 1990, 46, 691-692
9007765 CIFAs Na3 O15 SP 21 21 219.22; 12.831; 13.906
90; 90; 90
1645.1Kempa, P. B.; Wiebcke, M.; Felsche, J.
Structure of trisodium monothioarsenate dodecahydrate Sample: T = 213 K
Acta Crystallographica, Section C, 1990, 46, 729-732
9007766 CIFC16 Co4 O16 SnF -4 3 c17.255; 17.255; 17.255
90; 90; 90
5137.42Leigh, J. S.; Whitmire, K. H.
The structures of [Sn{Co(CO4)4}4] and [Pb{Co(CO)4}4]
Acta Crystallographica, Section C, 1990, 46, 732-736
9007767 CIFC16 Co4 O16 PbP c c n12.184; 12.267; 17.22
90; 90; 90
2573.72Leigh, J. S.; Whitmire, K. H.
The structures of [Sn{Co(CO4)4}4] and [Pb{Co(CO)4}4]
Acta Crystallographica, Section C, 1990, 46, 732-736
9007768 CIFCl Na3 OP m -3 m4.496; 4.496; 4.496
90; 90; 90
90.882Hippler, K.; Sitta, S.; Vogt, P.; Sabrowsky, H.
Structure of Na3OCl
Acta Crystallographica, Section C, 1990, 46, 736-738
9007769 CIFH4 K O7 VP 16.501; 7.882; 7.501
107.18; 95.5; 116.2
317.797Lapshin, A. E.; Smolin, Y. I.; Shepelev, Y. F.; Schwendt, P.; Gyepesova, D.
Structure of dipotassium aquadioxotetraperoxodivanadate(V) trihydrate Sample: T = 153 K
Acta Crystallographica, Section C, 1990, 46, 738-741
9007770 CIFH14 N4 O6 Ru S2P 1 21/c 16.2019; 7.0213; 11.761
90; 115.3; 90
463.015Condren, S. M.; Cordes, A. W.; Durham, B.
Structure of cis-tetraamminebis(hydrogensulfito)ruthenium(II)
Acta Crystallographica, Section C, 1990, 46, 889-890
9007771 CIFC8 Cl4 Hf O2P 21 21 217.914; 12.806; 14.357
90; 90; 90
1455.03Duraj, S. A.; Towns, R. L. R.; Baker, R. J.; Schupp, J.
Structure of cis-tetrachlorobis(tetrahydrofuran)hafnium(IV)
Acta Crystallographica, Section C, 1990, 46, 890-892
9007772 CIFC12 Cl2 Co N8 O10P -19.508; 9.428; 9.309
78.86; 105.08; 120.13
694.91Ganesh, V.; Seshasayee, M.; Aravamudan, G.; Heijdenrijk, D.; Schenk, H.
Structure of hexaaquacobalt(II) dichloride bis(hexamethylenetetramine)* tetrahydrate
Acta Crystallographica, Section C, 1990, 46, 949-951
9007773 CIFCr H16 N3 O10 P2P 1 21/c 17.825; 10.107; 15.322
90; 103.92; 90
1176.19Haromy, T. P.; Linck, C. F.; Cleland, W. W.; Sundaralingam, M.
Structures of the meridional and facial isomers of triamminechromium pyrophosphate dihydrate Sample: a) meridional monoaquatriammine(pyrophosphato)-chromium(III) dihydrate
Acta Crystallographica, Section C, 1990, 46, 951-957
9007774 CIFCr H14 N3 O9 P2P 1 21/c 18.695; 10.327; 11.913
90; 97.81; 90
1059.79Haromy, T. P.; Linck, C. F.; Cleland, W. W.; Sundaralingam, M.
Structures of the meridional and facial isomers of triamminechromium pyrophosphate dihydrate Sample: (b), alpha,beta,beta'-tridentate triammine(pyrophosphato) chromium(III)dihydrate dimer
Acta Crystallographica, Section C, 1990, 46, 951-957
9007775 CIFNa2 O18 S3 ThP 1 21/c 15.567; 16.81; 15.76
90; 91.925; 90
1474.01Habash, J.; Smith, A. J.
Structure of disodium triaquatri-u-sulfato-thorate(IV) trihydrate
Acta Crystallographica, Section C, 1990, 46, 957-960
9007776 CIFCl3 O6 YP 1 2/n 17.8346; 6.4729; 9.5817
90; 93.768; 90
484.862Bell, A. M. T.; Smith, A. J.
Structure of hexaaquadichloroyttrium(III) chloride
Acta Crystallographica, Section C, 1990, 46, 960-962
9007777 CIFC3 H8 Ag Ba O9 PP 1 21/a 16.578; 23.811; 6.61
90; 90.57; 90
1035.27Weichsel, A.; Lis, T.
Structure of silver(I) barium phosphoenolpyruvate trihydrate
Acta Crystallographica, Section C, 1990, 46, 962-965
9007779 CIFCa H16 Li O13 P3P -17.767; 10.144; 7.225
105.17; 102.76; 84.95
535.566Averbuch-Pouchot M T; Durif, A.
Crystal chemistry of cyclo-hexaphosphates. X. structure of dicalcium dilithium cyclo-hexaphosphate octahydrate
Acta Crystallographica, Section C, 1990, 46, 968-970
9007780 CIFBa2 Cu1.1 Ho2 O8 Pt0.9P c m n10.303; 5.668; 13.178
90; 90; 90
769.561Saito, Y.; Ukei, K.; Shishido, T.; Fukuda, T.
Structure of Ho2Ba2Cu1+xPt1-xO8(x=0.1)
Acta Crystallographica, Section C, 1990, 46, 970-972
9007781 CIFFe3 H11 N2.26 O32 Rb2.74 S6P -19.783; 9.586; 18.389
95.3; 93.19; 118.12
1504.77Mereiter K
Structure of a triclinic rubidium ammonium triaqua-u3-oxo-hexa-u-sulfato-triferrate(III) tetrahydrate, Rb2.74(NH4)2.26Fe3O(SO4)6.7H2O
Acta Crystallographica, Section C, 1990, 46, 972-976
9007782 CIFAg0.616 Nb S2P 63/m m c3.354; 3.354; 14.431
90; 90; 120
140.59Van der Lee, A.; Wiegers, A.; Haange, R. J.; de Boer, J. L.
Structure of Ag0.6NbS2
Acta Crystallographica, Section C, 1990, 46, 976-979
9007783 CIFH2 I2 O7 SrI 1 2/c 18.9003; 7.748; 9.6496
90; 90.23; 90
665.426Lutz, H. D.; Kellersohn, T.; Vogt, T.
Structural instability of the water molecule in Sr(IO3)2.H2O, a neutron diffraction study
Acta Crystallographica, Section C, 1990, 46, 979-981
9007784 CIFMg2 Pt SiP 63/m m c4.254; 4.254; 8.542
90; 90; 120
133.871Range, K. J.; Rau, F.; Klement, U.
Dimagnesium platinum silicon
Acta Crystallographica, Section C, 1990, 46, 1092-1093
9007785 CIFEr O4 VI 41/a :25.003; 5.003; 11.143
90; 90; 90
278.909Range, K. J.; Meister, H.
ErVO4-II, a scheelite-type high-pressure modification of erbium orthovanadate
Acta Crystallographica, Section C, 1990, 46, 1093-1094
9007786 CIFAs3 H2 Na3 O10C 1 2/c 110.86; 9.323; 18.27
90; 103; 90
1802.39Driss, A.; Jouini, T.
Structure d'un triarseniate: Na3H2As3O10
Acta Crystallographica, Section C, 1990, 46, 1185-1188
9007787 CIFMo5 O8 SnP 1 21/c 17.533; 9.268; 9.97
90; 109.73; 90
655.201Gougeon, P.; Potel, M.; Sergent, M.
Structure of SnMo5O8 containing bioctahedral Mo10 clusters
Acta Crystallographica, Section C, 1990, 46, 1188-1190
9007789 CIFGa2 Sn Ta5I 4/m c m10.354; 10.354; 5.1795
90; 90; 90
555.27Ye, J.; Horiuchi, H.; Shishido, T.; Ukei, K.; Fukuda, T.
Structure of Ta5SnGa2
Acta Crystallographica, Section C, 1990, 46, 1193-1195
9007790 CIFGa Sn2 V2A e a m6.7191; 18.798; 5.603
90; 90; 90
707.691Ye, J.; Horiuchi, H.; Shishido, T.; Fukuda, T.
Structure of V2Sn2Ga
Acta Crystallographica, Section C, 1990, 46, 1195-1197
9007791 CIFGd SiP n m a7.973; 3.858; 5.753
90; 90; 90
176.961Nagaki, D. A.; Simon, A.
Structure of gadolinium monosilicide
Acta Crystallographica, Section C, 1990, 46, 1197-1199
9007792 CIFLi O16 Rb4 S4P 417.615; 7.615; 29.458
90; 90; 90
1708.22Zuniga, F. J.; Etxebarria, J.; Madariaga, G.; Breczewski, T.
Structure and absolute chirality of Rb4LiH3(SO4)4 at 293 K
Acta Crystallographica, Section C, 1990, 46, 1199-1202
9007793 CIFGe8.5 Na4 O20I 41/a :215.0263; 15.0263; 7.3971
90; 90; 90
1670.19Fleet, M. E.
Refinement of the structure of sodium enneagermanate (Na4Ge9O20)
Acta Crystallographica, Section C, 1990, 46, 1202-1204
9007794 CIFLu O4 S5 U4I 4/m m m3.8014; 3.8014; 34.2
90; 90; 90
494.212Jaulmes, P. S.; Julien-Pouzol M; Dugue, J.; Laruelle, P.; Vovan, T.; Guittard, M.
Structure de l'oxysulfure d'uranium et de lutecium, (USO)4LuS
Acta Crystallographica, Section C, 1990, 46, 1205-1207
9007795 CIFC16 Br4 P2 TaP 1 21/c 18.493; 30.369; 8.898
90; 99.22; 90
2265.36Hovnanian, N.; Hubert-Pfalzgraf L G; Borgne, G. L.
Structures of two polymorphs of cis-TaBr4(PhPMe2)2 Sample: 1
Acta Crystallographica, Section C, 1990, 46, 1207-1209
9007796 CIFC16 Br4 P2 TaP 21 21 2114.38; 19.17; 8.28
90; 90; 90
2282.5Hovnanian, N.; Hubert-Pfalzgraf L G; Borgne, G. L.
Structures of two polymorphs of cis-TaBr4(PhPMe2)2 Sample: 2
Acta Crystallographica, Section C, 1990, 46, 1207-1209
9007797 CIFBr2 K4 OI 4/m m m5.145; 5.145; 16.527
90; 90; 90
378.875Hippler, K.; Sitta, S.; Vogt, P.; Sabrowsky, H.; Walz, L.
Structure of K4OBr2
Acta Crystallographica, Section C, 1990, 46, 1359-1360
9007798 CIFAl H14 Na O9.25 Si3P n m a9.868; 10.082; 10.098
90; 90; 90
1004.64Hansen, S.; Hakansson, U.; Falth, L.
Structure of synthetic zeolite Na-P2
Acta Crystallographica, Section C, 1990, 46, 1361-1362
9007799 CIFAl0.225 H5.5 Na0.444 O2.611 Si0.795I 41/a m d :29.9989; 9.9989; 10.0697
90; 90; 90
1006.75Hakansson, U.; Falth, L.; Hansen, S.
Structure of a high-silica variety of zeolite Na-P
Acta Crystallographica, Section C, 1990, 46, 1363-1364
9007800 CIFH3 Na3 O5 SiP 1 21/c 17.898; 5.96; 11.142
90; 105.57; 90
505.231Schmid, R. L.; Felsche, J.
Structure of trisodium hydrogenorthosilicate monohydrate
Acta Crystallographica, Section C, 1990, 46, 1365-1368
9007802 CIFAl5 Ca1.88 H12 Na O26 Si5 Sr0.12P n c n13.1043; 13.0569; 13.2463
90; 90; 90
2266.46Stahl, K.; Kvick, A.; Smith, J. V.
Thomsonite, a neutron diffraction study at 13 K Sample: T = 13 K
Acta Crystallographica, Section C, 1990, 46, 1370-1373
9007803 CIFK2 O10 Si4 ZnP 21 21 2110.0673; 14.047; 7.0673
90; 90; 90
999.425Kohara, S.; Kawahara, A.
Structure of synthetic dipotassium zinc tetrasilicate
Acta Crystallographica, Section C, 1990, 46, 1373-1376

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